2-[[(2S)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-2-phenyl-ethanoyl]amino]ethanoate

Systemtic Name: 2-[[(2S)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-2-phenyl-ethanoyl]amino]ethanoate Openeye Name: 2-[[(2S)-2-(4-oxo-1,2,3-benzotriazin-3-yl)-2-phenyl-acetyl]amino]acetate CAS Name: 2-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)-2-phenylethyl]amino]acetate IUPAC Name: 2-[[(2S)-2-(4-oxo-1,2,3-benzotriazin-3-yl)-2-phenylacetyl]amino]acetate Traditional Name: 2-[[(2S)-2-(4-keto-1,2,3-benzotriazin-3-yl)-2-phenyl-acetyl]amino]acetate Formula: C17H13N4O4- MolecularWeight: 337.30952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NCC(=O)[O-])N2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C(=O)NCC(=O)[O-])N2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H14N4O4/c22-14(23)10-18-16(24)15(11-6-2-1-3-7-11)21-17(25)12-8-4-5-9-13(12)19-20-21/h1-9,15H,10H2,(H,18,24)(H,22,23)/p-1/t15-/m0/s1